5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid

C8H10N2O2 — CID 82414298

IUPAC5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid
SMILESO=C(O)C1CCCn2cncc21
InChIInChI=1S/C8H10N2O2/c11-8(12)6-2-1-3-10-5-9-4-7(6)10/h4-6H,1-3H2,(H,11,12)
InChIKeyLJARASSVBYJONB-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.85
Rot. Bonds1

About 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid

5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid (PubChem CID 82414298) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid
PubChem CID82414298
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid
SMILESO=C(O)C1CCCn2cncc21
InChIInChI=1S/C8H10N2O2/c11-8(12)6-2-1-3-10-5-9-4-7(6)10/h4-6H,1-3H2,(H,11,12)
InChIKeyLJARASSVBYJONB-UHFFFAOYSA-N
XLogP0.85
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

UK 396082
CID 11241908
(S)-5-Amino-2-((1-(trans-4-methylcyClohexyl)-1H-imidazol-4-yl)methyl)pentanoic acid
CID 53464327
(+/-)-5-amino-2-((1-propyl-1H-imidazol-4-yl)methyl)pentanoic acid
CID 9816170
6-Amino-2-[1-(3-methyl-butyl)-1H-imidazol-4-yl]-hexanoic acid
CID 9900049
Pilocarbine
CID 44309527
ent-(2S)-5-amino-2-[(1-n-propyl-1H-imidazol-4-yl)methyl]-pentanoic acid
CID 15974385
5-Amino-2-(1H-imidazol-4-yl)-pentanoic acid
CID 9855661
Rel-(1s,4s)-5-Amino-2-((1-(4-methylcyClohexyl)-1H-imidazol-4-yl)methyl)pentanoic acid
CID 53464326
5-Amino-2-[(1-cyclohexylimidazol-4-yl)methyl]pentanoic acid
CID 53465144
5-Amino-2-[[1-(3-ethylcyclobutyl)imidazol-4-yl]methyl]pentanoic acid
CID 53465146
5-Amino-2-[[1-(3-methylcyclobutyl)imidazol-4-yl]methyl]pentanoic acid
CID 53465147
5-Amino-2-[[1-(3-methylcyclohexyl)imidazol-4-yl]methyl]pentanoic acid
CID 53465216

Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
The IUPAC name of 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid (CID 82414298) is 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
The canonical SMILES for 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid is O=C(O)C1CCCn2cncc21.
What is the InChIKey of 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
The InChIKey is LJARASSVBYJONB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c11-8(12)6-2-1-3-10-5-9-4-7(6)10/h4-6H,1-3H2,(H,11,12).
What are the key properties of 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid has a molecular weight of 166.18 g/mol, XLogP of 0.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 82414298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).